EGF-05224 Red

Cn1c(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc2c(=O)oc3ccccc3c21
0.347
Platform Score
2D Structure
EGF-05224
C25H23N3O5 | Exact mass: 445.1638
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
77
TPSA
446
MW
0
HBD
3.0
SlogP
Display Controls
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EGFR Docking Result
N/A
kcal/mol (molecular docking)
Docking Rank#- of 1,249
Consensus Score-
ReceptorEGFR (PDB: 1M17)
Selective No
Selectivity Profile
ADMET Profile
BBB (BOILED-Egg) BBB- (non-penetrant)
ADMET Status Pass (no hard fails)
CNS Drug-Likeness
Physicochemical Properties
Molecular Weight445.50 Da
TPSA77.2 A^2
HBD0
HBA7
SlogP2.97
Fsp30.280
Rotatable Bonds3
Rings6 (4 aromatic)
QED0.452
SA Score2.49 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC25H23N3O5
Exact Mass445.1638
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes